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Seselin

Seselin structure

CAS No:
523-59-1
Formula:
C14H12O3
Chemical Name:
Seselin
Synonyms:
2H,8H-Benzo[1,2-b:3,4-b′]dipyran-2-one,8,8-dimethyl-;Seselin;2H-1-Benzopyran-6-acrylic acid,5-hydroxy-2,2-dimethyl-,δ-lactone;8,8-Dimethyl-2H,8H-benzo[1,2-b:3,4-b′]dipyran-2-one;Amyrolin;Seseline
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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Description

ChEBI: A natural product found in Citropsis articulata.

Solid

Seselin is a member of coumarins. It has a role as a metabolite.

Seselin Basic Attributes

Molecular Weight：

228.247

Exact Mass：

228.24

UNII：

5634E8957P

DSSTox ID：

DTXSID60200322

HScode：

2932999099

Characteristics

PSA：

35.5

XLogP3：

2.8

Appearance：

Solid

Density：

1.351 g/cm³ @ Temp: 18 °C

Melting Point：

119-124 °C

Boiling Point：

403ºC at 760 mmHg

Flash Point：

170.5ºC

Refractive Index：

1.583

Water Solubility：

60.34 mg/L @ 25 °C (est)

Drug Information

MeSH Entry Terms：

seselin

Computed Properties

Molecular Weight:228.24
XLogP3:2.8
Hydrogen Bond Acceptor Count:3
Exact Mass:228.078644241
Monoisotopic Mass:228.078644241
Topological Polar Surface Area:35.5
Heavy Atom Count:17
Complexity:394
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Seselin

Description
Basic Attributes
Characteristics
Drug Information
Computed Properties
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Seselin

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